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List of works by Ahmet Altun

A simple method for studying the molecular mechanisms of ultraviolet and violet reception in vertebrates

scientific article

Adaptive evolutionary paths from UV reception to sensing violet light by epistatic interactions

scientific article

Color Tuning in rhodopsins: the origin of the spectral shift between the chloride-bound and anion-free forms of halorhodopsin.

scientific article published on 16 March 2012

Color tuning in short wavelength-sensitive human and mouse visual pigments: ab initio quantum mechanics/molecular mechanics studies.

scientific article published on October 2009

Combined Quantum Mechanical/Molecular Mechanical Study on the Pentacoordinated Ferric and Ferrous Cytochrome P450camComplexes

Combined experimental and theoretical studies on the vibrational spectra of 2-quinolinecarboxaldehyde

article

Common system setup for the entire catalytic cycle of cytochrome P450(cam) in quantum mechanical/molecular mechanical studies

scientific article published in October 2007

Contributors

Correlated Ab Initio and Density Functional Studies on H2 Activation by FeO(.).

scientific article published on September 2014

Correlation effects and orbital magnetism of Co clusters

scholarly article in Physical Review B, vol. 93 no. 22, June 2016

Effect of Electron Correlation on Intermolecular Interactions: A Pair Natural Orbitals Coupled Cluster Based Local Energy Decomposition Study

scientific article published on 13 December 2018

Electron-conformational study for the structure-hallucinogenic activity relationships of phenylalkylamines.

scientific article published in September 2003

Epistatic adaptive evolution of human color vision

scientific article published in December 2014

Experimental and theoretical studies on IR, Raman, and UV-Vis spectra of quinoline-7-carboxaldehyde

scientific article published on 25 June 2014

HFLD: A Nonempirical London Dispersion-Corrected Hartree-Fock Method for the Quantification and Analysis of Noncovalent Interaction Energies of Large Molecular Systems †

scientific article published on 04 October 2019

Local Energy Decomposition of Open-Shell Molecular Systems in the Domain-Based Local Pair Natural Orbital Coupled Cluster Framework

scientific article published on 18 February 2019

Local energy decomposition analysis of hydrogen-bonded dimers within a domain-based pair natural orbital coupled cluster study.

scientific article

Mechanism of spectral tuning going from retinal in vacuo to bovine rhodopsin and its mutants: multireference ab initio quantum mechanics/molecular mechanics studies.

scientific article published on December 2008

Molecular convergence of infrared vision in snakes.

scientific article

Multireference ab initio quantum mechanics/molecular mechanics study on intermediates in the catalytic cycle of cytochrome P450(cam).

scientific article published in December 2008

Nitrate reduction enables safer aryldiazonium chemistry

scientific article published on 25 April 2024

Open-Shell Variant of the London Dispersion-Corrected Hartree–Fock Method (HFLD) for the Quantification and Analysis of Noncovalent Interaction Energies

scientific article published on 15 February 2022

Principal active species of horseradish peroxidase, compound I: a hybrid quantum mechanical/molecular mechanical study

scientific article

QM/MM Study of Dehydro and Dihydro β-Ionone Retinal Analogues in Squid and Bovine Rhodopsins: Implications for Vision in Salamander Rhodopsin ⬇️

scientific article published on October 21, 2010

Spectral tuning in visual pigments: an ONIOM(QM:MM) study on bovine rhodopsin and its mutants.

scientific article published on 13 May 2008

Synthesis, structure-activity relationships, and in vitro antibacterial and antifungal activity evaluations of novel pyrazole carboxylic and dicarboxylic acid derivatives.

scientific article

Systematic QM/MM investigation of factors that affect the cytochrome P450-catalyzed hydrogen abstraction of camphor

scientific article published in September 2006

The effect of heme environment on the hydrogen abstraction reaction of camphor in P450cam catalysis: a QM/MM study

scientific article published on March 2006

Theoretical perspective on the structure and mechanism of cytochrome P450 enzymes.

scientific article

Thermal studies and vibrational analyses of m-methylaniline complexes of Zn(II), Cd(II) and Hg(II) bromides ⬇️

scientific article published on June 1, 2003

Thermal, vibrational and EPR studies of Cu(II) bromide bis(p-methylaniline) and bis(m-methylaniline) complexes.

scientific article published in January 2004

Water as biocatalyst in cytochrome P450

scientific article published on 01 January 2011

What is the Active Species of Cytochrome P450 during Camphor Hydroxylation? QM/MM Studies of Different Electronic States of Compound I and of Reduced and Oxidized Iron−Oxo Intermediates

article

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